1SIU
KUMAMOLISIN-AS E78H MUTANT
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH2R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2003-04-16 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 |
Unit cell lengths | 42.160, 45.040, 49.430 |
Unit cell angles | 114.82, 106.36, 102.03 |
Refinement procedure
Resolution | 10.000 - 2.310 |
R-factor | 0.1591 |
R-free | 0.28660 |
Structure solution method | DIRECT REFINEMENT |
Starting model (for MR) | WILD-TYPE KUMAMOLISIN-AS APOENZYME |
RMSD bond length | 0.008 |
RMSD bond angle | 0.030 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | SHELXL |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.390 |
High resolution limit [Å] | 2.310 | 2.310 |
Number of reflections | 12280 | |
<I/σ(I)> | 17 | 6.1 |
Completeness [%] | 94.9 | 80.6 |
Redundancy | 1.9 | 1.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 298 | PEG 8000, Ammonium Sulfate, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |